5-[2-(4-Fluoro-phenyl)-2H-pyrazol-3-yl]-3-(4-methoxy-phenyl)-benzo[c]isoxazole

HCID 73053002
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Basic information

Standard SMILES
COc1ccc(-c2onc3ccc(-c4ccnn4-c4ccc(F)cc4)cc23)cc1
InChIKey
MZDNLISHXFNCQD-UHFFFAOYSA-N
Molecular formula
C23H16FN3O2
Average molar mass
385.4 g/mol
Monoisotopic mass
385.12265492

Names & identifiers

Preferred name
5-[2-(4-Fluoro-phenyl)-2H-pyrazol-3-yl]-3-(4-methoxy-phenyl)-benzo[c]isoxazole
IUPAC
5-[2-(4-fluorophenyl)pyrazol-3-yl]-3-(4-methoxyphenyl)-2,1-benzoxazole

Names & synonyms

SCHEMBL15556946MZDNLISHXFNCQD-UHFFFAOYSA-N5-[2-(4-Fluoro-phenyl)-2H-pyrazol-3-yl]-3-(4-methoxy-phenyl)-benzo[c]isoxazole

Database identifiers

PubChem CID
73053002

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
53.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
29

Related reactions

1 records
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Compound notes

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